[2-(2-ethyl-4-iodanyl-6-methyl-phenyl)-8-methoxy-3-oxidanylidene-4-oxaspiro[4.5]dec-1-en-1-yl] 3-methylbutanoate

Systemtic Name: [2-(2-ethyl-4-iodanyl-6-methyl-phenyl)-8-methoxy-3-oxidanylidene-4-oxaspiro[4.5]dec-1-en-1-yl] 3-methylbutanoate Openeye Name: [2-(2-ethyl-4-iodo-6-methyl-phenyl)-8-methoxy-3-oxo-4-oxaspiro[4.5]dec-1-en-1-yl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [2-(2-ethyl-4-iodo-6-methylphenyl)-8-methoxy-3-oxo-4-oxaspiro[4.5]dec-1-en-1-yl] ester IUPAC Name: [2-(2-ethyl-4-iodo-6-methylphenyl)-8-methoxy-3-oxo-4-oxaspiro[4.5]dec-1-en-1-yl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid [2-(2-ethyl-4-iodo-6-methyl-phenyl)-3-keto-8-methoxy-4-oxaspiro[4.5]dec-1-en-1-yl] ester Formula: C24H31IO5 MolecularWeight: 526.40441

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)I)C)C2=C(C3(CCC(CC3)OC)OC2=O)OC(=O)CC(C)C

Isomeric SMILES

CCC1=C(C(=CC(=C1)I)C)C2=C(C3(CCC(CC3)OC)OC2=O)OC(=O)CC(C)C

InChI

InChI=1S/C24H31IO5/c1-6-16-13-17(25)12-15(4)20(16)21-22(29-19(26)11-14(2)3)24(30-23(21)27)9-7-18(28-5)8-10-24/h12-14,18H,6-11H2,1-5H3